| SpectraBase Spectrum ID |
ESGA0iYzsP5 |
| Name |
(R)-4A-Methyl-2-hydroxy-1,2,3,4,4A,5,6,7A-octahydro-7-indenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-10-4-2-7(11)6-8(10)9(12)3-5-10/h7-8,11H,2-6H2,1H3/t7-,8-,10+/m0/s1 |
| InChIKey |
JNWMHOQIQGADCY-OYNCUSHFSA-N |
| Molecular Weight |
168.236 g/mol |
| SMILES |
[C@@]12([C@@](CCC2=O)(CC[C@@](C1)(O)[H])C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827963 |
